K
Kwang S. Kim
Researcher at Ulsan National Institute of Science and Technology
Publications - 671
Citations - 71259
Kwang S. Kim is an academic researcher from Ulsan National Institute of Science and Technology. The author has contributed to research in topics: Graphene & Ab initio. The author has an hindex of 97, co-authored 642 publications receiving 62053 citations. Previous affiliations of Kwang S. Kim include Asia Pacific Center for Theoretical Physics & IBM.
Papers
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Lower Electric Field-Driven Magnetic Phase Transition and Perfect Spin Filtering in Graphene Nanoribbons by Edge Functionalization
TL;DR: From the current-voltage characteristics of the edge-modified zGNR under an in-plane transverse electric field, a remarkable perfect spin filtering feature is found, which can be utilized for a molecular spintronic device.
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Electron Transport in Graphene Nanoribbon Field-Effect Transistor under Bias and Gate Voltages: Isochemical Potential Approach
TL;DR: The isochemical potential scheme to describe the top/ back-gate effect using external potential is presented and the change in electronic state under the modulation of chemical potential and the subsequent electron transport phenomena in zGNR transistor under substantial top-/back-gate and bias voltages is examined.
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σ to π conformational transition: Interactions of the water trimer with π systems
TL;DR: In this paper, the authors investigated the interaction of the water trimer with the aromatic π systems at the second-order Moller-Plesset level of theory using both the 6-31+G* and aug-cc-pVDZ basis sets.
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Non-adiabatic dynamics of ring opening in cyclohexa-1,3-diene described by an ensemble density-functional theory method
TL;DR: In this article, the dynamics of the ring opening in the S1 state of cyclohexa-1,3-diene (CHD) is studied by a new direct mixed quantum-classical non-adiabatic dynamics approach which employs the decoherence-induce.
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Structures, vibrational frequencies, and infrared spectra of the hexa-hydrated benzene clusters
TL;DR: In this article, the effects of benzene on the structures, harmonic vibrational frequencies, and infrared (IR) intensities for the four low-lying energy conformers, Ring, Book, Cage, and Prism structures, were investigated.